CID 386888

Nsc679746

Structural Information

Molecular Formula
C20H34O5
SMILES
CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(CO)OCCOCCO
InChI
InChI=1S/C20H34O5/c1-19(2,3)15-11-14(12-16(18(15)23)20(4,5)6)17(13-22)25-10-9-24-8-7-21/h11-12,17,21-23H,7-10,13H2,1-6H3
InChIKey
JTVUWCWBNGVCOX-UHFFFAOYSA-N
Compound name
2,6-ditert-butyl-4-[2-hydroxy-1-[2-(2-hydroxyethoxy)ethoxy]ethyl]phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

354.24063 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 355.24791 188.9
[M+Na]+ 377.22985 193.3
[M-H]- 353.23335 188.0
[M+NH4]+ 372.27445 200.7
[M+K]+ 393.20379 191.0
[M+H-H2O]+ 337.23789 183.3
[M+HCOO]- 399.23883 202.1
[M+CH3COO]- 413.25448 211.2
[M+Na-2H]- 375.21530 188.9
[M]+ 354.24008 193.9
[M]- 354.24118 193.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.